4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=15319.113243952263 stress="-2556.833863712269 1122.2974121242264 549.7617370770844 1122.2974121242264 -2233.1011636538174 371.09040817630876 549.7617370770844 371.09040817630876 -2043.036122813157" pbc="F T T" Xe 0.23171545 0.18190327 -0.17816502 -20059.16993665 -15895.94028305 26912.01889592 Xe 1.62780321 1.32965408 0.00710170 8247.72129887 9261.04613294 3290.63456741 Xe 1.28220450 0.28278197 1.56210000 51088.06381996 -37072.40143408 -19502.46813179 Xe 0.13362859 1.32702941 1.57034430 -39276.61518218 43707.29558419 -10700.18533154